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MCP servers tagged materials-science
13 live MCP servers tagged "materials-science", ranked by trust score. Tags come from package metadata and repository topics, so this list covers servers across every category that work with materials-science.
Chemgraph
Agentic framework for computational chemistry and materials science workflows
Catgo LRG
AI-driven workbench for computational materials science — interactive 3D structure viewer, natural-language CatBot assistant, visual DAG workflow engine, HPC job submission. Tauri…
SciLink
LLM-powered agents for scientific research automation
SciCrucible
基于claude的科学智能知识库：从文献摄入-知识分析-科学讨论-学术写作的全闭环。
CrystalPilot Preview
Agent-driven single-crystal X-ray structure solution and refinement workbench
AutoPhaseAnalysis
Automated XRD phase identification and Rietveld refinement — a dara tree search explores phase combinations and BGMN-refines each one, no manual peak matching. Ranked solutions wi…
Dft Autopilot MCP
BYO-HPC DFT computational chemistry (Quantum ESPRESSO / VASP / Gaussian) orchestration — an MCP server + Claude plugin that runs on your own HPC (SCNet / Slurm / local).
Awesome Materials AI
Curated list of language models, agents, and MCP servers for materials science and chemistry.
Corvex
LLM agent orchestration for scientific workflows. Python 3.12, LiteLLM, BoTorch, ASE, Streamlit UI, MCP server and client.
Web Refinement
Crystal & magnetic structure refinement in the browser — Rietveld, single-crystal F², and pair-distribution-function fitting on one pure-TypeScript engine; agent-ready via MCP.
Sandboxaq
SandboxAQ — independent third-party profile of a public API surface, by API Evangelist. SandboxAQ (SB Technology, Inc.) builds Large Quantitative Models (LQMs) — AI systems that f…
Materials Discovery Agent
LangGraph ReAct agent for materials discovery — integrates Materials Project, PubChem, SureChEMBL, and semantic web search.
Matscout
MCP server with 25 tools and a two phase research agent over Materials Project. Personal course project.